comp-chem/cp2k
1
0
Fork 0
mirror of https://github.com/cp2k/cp2k.git synced 2026-07-28 06:05:29 -04:00
Code Issues Projects Releases Packages Wiki Activity Actions
cp2k/tests/QS/regtest-gapw
History
Exact
Dynamics of Condensed Matter 099792108e
Add conservative AUTO default for cell canonicalization (#5318) 
Co-authored-by: Thomas D. Kuehne <tkuehne@cp2k.org>
2026-05-30 20:11:58 +02:00
..
Be_GAPW.inp Format all input files 2023-12-18 22:41:19 +01:00
Be_GAPW_fine_xc.inp GAPW: final accurate XC integration coverage toward a future default (#5127) 2026-05-04 14:21:54 +02:00
H-gapw-all.inp Format all input files 2023-12-18 22:41:19 +01:00
H2O-gapw-all.inp Format all input files 2023-12-18 22:41:19 +01:00
H2O-gapw-all_loc_list.inp Format all input files 2023-12-18 22:41:19 +01:00
H2O-gapw-all_localize.inp Format all input files 2023-12-18 22:41:19 +01:00
H2O-gapw-all_localize_crazy.inp Format all input files 2023-12-18 22:41:19 +01:00
H2O-gapw-all_localize_crazy_noortho.inp Add conservative AUTO default for cell canonicalization (#5318) 2026-05-30 20:11:58 +02:00
H2O-gapw-all_localize_noortho.inp Add conservative AUTO default for cell canonicalization (#5318) 2026-05-30 20:11:58 +02:00
H2O-gapw-all_noortho.inp Add conservative AUTO default for cell canonicalization (#5318) 2026-05-30 20:11:58 +02:00
H2O-gapw-gth-pvh.inp Format all input files 2023-12-18 22:41:19 +01:00
H2O-gapw-gth.inp Format all input files 2023-12-18 22:41:19 +01:00
H2O-gapwxc-gth.inp Format all input files 2023-12-18 22:41:19 +01:00
h2o_dist.inp Format all input files 2023-12-18 22:41:19 +01:00
H2S-gapw-gop-ot.inp Format all input files 2023-12-18 22:41:19 +01:00
H2S-gapw-gop.inp Format all input files 2023-12-18 22:41:19 +01:00
H2S-gapw-ot.inp Format all input files 2023-12-18 22:41:19 +01:00
H2S-gapw.inp Format all input files 2023-12-18 22:41:19 +01:00
He2-all-md.inp Format all input files 2023-12-18 22:41:19 +01:00
He2-all.inp Format all input files 2023-12-18 22:41:19 +01:00
HF_all_voronoi.inp Format all input files 2023-12-18 22:41:19 +01:00
HF_gapw_all_LB.inp Format all input files 2023-12-18 22:41:19 +01:00
HF_gapw_TPSS.inp Format all input files 2023-12-18 22:41:19 +01:00
HF_voronoi.inp Format all input files 2023-12-18 22:41:19 +01:00
Na_atom.inp Format all input files 2023-12-18 22:41:19 +01:00
OF_gapw_all_lsd_LB.inp Format all input files 2023-12-18 22:41:19 +01:00
TEST_FILES.toml Canonicalize general input cells consistently (#5307) 2026-05-28 00:09:27 +02:00
xrd.inp Format all input files 2023-12-18 22:41:19 +01:00